Hydrochloric Acid → HCID 67059707, compound

HRID 682207Notes

Reaction equation

HRID 682207 reaction equation
[CH2:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[N:18]1[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]1.[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[CH3:43][N:44]([CH3:45])[CH2:46][CH2:47][CH2:48][N:49]=[C:50]=[N:51][CH2:52][CH3:53].[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[ClH:42].[NH2:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[OH2:31].[OH:32][n:33]1[c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[NH2:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:8])[N:21]2[CH2:20][CH2:19][N:18]([CH2:11][c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[CH2:23][CH2:22]2)[cH:9][cH:10]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 184966-Aminonicotinic acidHCID 757711-HydroxybenzotriazoleHCID 759941-Benzylpiperazine

Product 1

HCID 67059707HCID 67059707, compound

Sources & evidence

ORD record
ord-88a6398574824971888014fbefddee39
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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